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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM50046361'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50046361
PNG
(CHEMBL2370418 | {2-[2-(1-Formyl-4-guanidino-butylc...)
Show SMILES [#6]C([#6])([#6])[#8]-[#6](=O)-[#7]-[#6@@H](-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6]=O)-c1ccsc1
Show InChI InChI=1S/C22H34N6O5S/c1-22(2,3)33-21(32)27-17(14-8-11-34-13-14)19(31)28-10-5-7-16(28)18(30)26-15(12-29)6-4-9-25-20(23)24/h8,11-13,15-17H,4-7,9-10H2,1-3H3,(H,26,30)(H,27,32)(H4,23,24,25)/t15-,16-,17+/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
PubMed
n/an/a 190n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against factor Xa


J Med Chem 36: 314-9 (1993)


BindingDB Entry DOI: 10.7270/Q2930S8J
More data for this
Ligand-Target Pair